Cas no 838820-83-0 (1H-Indazole, 1-(4-bromophenyl)-)
838820-83-0 structure
Product Name:1H-Indazole, 1-(4-bromophenyl)-
CAS No:838820-83-0
MF:C13H9BrN2
MW:273.127961874008
CID:1813185
PubChem ID:11277309
Update Time:2025-04-21
1H-Indazole, 1-(4-bromophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazole, 1-(4-bromophenyl)-
- 838820-83-0
- DB-406624
- SCHEMBL19780904
- 1-(4-bromophenyl)-1h-indazole
- AKOS015963830
-
- Inchi： 1S/C13H9BrN2/c14-11-5-7-12(8-6-11)16-13-4-2-1-3-10(13)9-15-16/h1-9H
- InChI Key： CRGBRERVLZVHEK-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)N1C2C=CC=CC=2C=N1
Computed Properties
- Exact Mass: 271.99491g/mol
- Monoisotopic Mass: 271.99491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 238
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.9
- Topological Polar Surface Area: 17.8?2
1H-Indazole, 1-(4-bromophenyl)- Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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